SEQUENCE: MLDAERLKHLIVTPSGAGEQNMIGMTPTVIAVHYLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLCGAVKWLILEKQKPDGVFQEDAPVIHQEMIGGLRNNNEKDMALTAFVLISLQEAKDICEEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQAISCGSPPPILNGRISYYSTPIAVGTVIRYSCSGTFRLIGEKSLLCITKDKVDGTWDKPAPKCEYFNKYSSCPEPIVPGGYKIRGSTPYRHGDSVTFACKTNFSMNGNKSVWCQANNMWGPTRLPTCVSX
SCORE:     score     fa_atr     fa_rep     fa_sol    fa_intra_atr_xover4    fa_intra_rep_xover4    fa_intra_sol_xover4    lk_ball    lk_ball_iso    lk_ball_bridge    lk_ball_bridge_uncpl    fa_elec    fa_intra_elec    hbond_sr_bb    hbond_lr_bb    hbond_bb_sc    hbond_sc    dslf_fa13    coordinate_constraint      omega    fa_dun_dev    fa_dun_rot    fa_dun_semi    p_aa_pp    hxl_tors        ref    sugar_bb    rama_prepro    cart_bonded       time                           description
REMARK BINARY SILENTFILE
SCORE:  -1310.945  -2768.969    301.386   1843.715               -150.369                 45.317                 97.262    977.161      -1059.035            -4.245                 -28.484   -895.062         -108.915       -233.164        -74.369        -98.174     -63.310       -6.809                   26.648      4.230        36.869       193.962        349.991    -95.814      86.408    -33.370       0.000         78.270        267.924  10279.000 HKH_2021_1GHQ_run_1_complex.130_chain_B_15_0000100001_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_1_complex.130_chain_B_15_0000100001_0000001_0
FOLD_TREE  EDGE 437 278 2  EDGE 278 1 -1  EDGE 278 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_1_complex.130_chain_B_15_0000100001_0000001_0
RT 0.73076 0.0325027 0.68186 -0.247223 0.94366 0.219971 -0.636295 -0.329318 0.697624 -28.616 -17.5873 12.9331   HKH_2021_1GHQ_run_1_complex.130_chain_B_15_0000100001_0000001_0
RT -0.98383 -0.128439 0.124824 0.171316 -0.471599 0.865012 -0.0522342 0.872409 0.485977 -0.526152 1.12921 1.87703   HKH_2021_1GHQ_run_1_complex.130_chain_B_15_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_1_complex.130_chain_B_15_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_1_complex.130_chain_B_15_0000100001_0000001_0
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LPFn1C54/kKkh4MrQlib1C9kwlKUf1XrQMVc1ClXejKES2frQO0X1CJpIhKUS+crQ5Zu0C12BnKEN7XrQntt0CZ6ipKkFwQrQ+WN0CxQ+kKk7JUrQQcZ1C9oZjK0XCJrQRQy1CJyQnK05karQ4sm0CxRqnKUEEgrQdEO0Cd7cqKUDARrQPYF1Cld+qK0uoTrQoK10CVPApK0ChIrQJntzCFe3lKUNSUrQvLV0CNEWkKk3EMrQ4pN0CJ3OjKkAdZrQ HKH_2021_1GHQ_run_1_complex.130_chain_B_15_0000100001_0000001_0
Lguf1CpNMkKUaBqrQ/+e1Cd1OiKUrlyrQydx0CpZNhKU8I0rQloq0CNqDfKE6m4rQPlT0ChpwiKk/fyrQ5wu1CBnfjKkQ78rQ8jZ2C1ZWkKExD8rQWmj1ChyImK0e8rrQ7qz1C5SjgKkgbwrQKZa1Ch2LlKkz++rQWDs1C9cCiKUsXDsQTYh2Clu+kKkjCDsQ HKH_2021_1GHQ_run_1_complex.130_chain_B_15_0000100001_0000001_0
LsRIyChNJaKksu9jQsRoyChNJaKksu9jQsRIyChNJcKksu9jQ HKH_2021_1GHQ_run_1_complex.130_chain_B_15_0000100001_0000001_0
SCORE:  -1240.236  -2758.279    322.796   1835.529               -153.136                 46.801                102.912    958.460      -1054.190            -4.562                 -31.124   -898.778         -105.413       -232.682        -69.565       -106.835     -67.842       -5.525                   47.904      8.710        36.169       191.556        350.572    -99.608      84.588    -33.370       0.000         84.506        310.171   7539.000 HKH_2021_1GHQ_run_2_complex.725_chain_B_1_0000200002_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_2_complex.725_chain_B_1_0000200002_0000001_0
FOLD_TREE  EDGE 437 276 2  EDGE 276 1 -1  EDGE 276 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_2_complex.725_chain_B_1_0000200002_0000001_0
RT -0.177552 0.303628 0.936101 0.713936 0.694425 -0.089826 -0.677326 0.652368 -0.340067 -24.5734 -32.3311 44.5652   HKH_2021_1GHQ_run_2_complex.725_chain_B_1_0000200002_0000001_0
RT 0.134059 -0.978003 0.159809 -0.483354 -0.205313 -0.851009 0.8651 0.0368409 -0.500245 -1.02959 -1.10829 -1.58597   HKH_2021_1GHQ_run_2_complex.725_chain_B_1_0000200002_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKH[HIS_D]LIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_2_complex.725_chain_B_1_0000200002_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_2_complex.725_chain_B_1_0000200002_0000001_0
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LYzHvCda0XKkZCjjQYznvCda0XKkZCjjQYzHvCda0ZKkZCjjQ HKH_2021_1GHQ_run_2_complex.725_chain_B_1_0000200002_0000001_0
SCORE:  -1338.010  -2734.874    292.665   1810.299               -151.152                 45.268                 99.112    957.609      -1042.399            -4.262                 -29.506   -886.744         -111.357       -234.097        -72.915       -100.040     -69.041       -6.961                   28.352      3.809        32.902       197.149        346.292    -97.696      86.082    -33.370       0.000         71.602        265.265  26887.000 HKH_2021_1GHQ_run_2_complex.291_chain_B_8_0000100001_0000001_1
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_2_complex.291_chain_B_8_0000100001_0000001_1
FOLD_TREE  EDGE 437 277 2  EDGE 277 1 -1  EDGE 277 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_2_complex.291_chain_B_8_0000100001_0000001_1
RT 0.300514 0.912976 -0.275982 -0.791583 0.400157 0.461813 0.53206 0.0796814 0.842949 -9.2916 -12.2997 -12.7931   HKH_2021_1GHQ_run_2_complex.291_chain_B_8_0000100001_0000001_1
RT -0.357865 -0.270127 0.893848 0.198906 -0.957326 -0.209675 0.912343 0.102757 0.396323 0.19156 -0.689609 3.05266   HKH_2021_1GHQ_run_2_complex.291_chain_B_8_0000100001_0000001_1
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_2_complex.291_chain_B_8_0000100001_0000001_1
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_2_complex.291_chain_B_8_0000100001_0000001_1
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LvIwwCxaAcKkyQ/jQvIQxCxaAcKkyQ/jQvIwwCxaAeKkyQ/jQ HKH_2021_1GHQ_run_2_complex.291_chain_B_8_0000100001_0000001_1
SCORE:  -1346.557  -2755.637    293.605   1823.151               -151.625                 46.752                 96.534    961.590      -1047.143            -3.863                 -26.215   -894.591         -109.894       -230.135        -71.995       -109.605     -65.550       -6.766                   22.701      4.668        34.678       194.528        349.885    -95.898      85.205    -33.370       0.000         72.853        269.582  23123.000 HKH_2021_1GHQ_run_1_complex.364_chain_B_4_0000100001_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_1_complex.364_chain_B_4_0000100001_0000001_0
FOLD_TREE  EDGE 437 276 2  EDGE 276 1 -1  EDGE 276 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_1_complex.364_chain_B_4_0000100001_0000001_0
RT -0.341135 -0.354223 -0.87072 -0.366804 -0.802691 0.470257 -0.865495 0.479804 0.143896 -2.90844 -15.1859 35.747   HKH_2021_1GHQ_run_1_complex.364_chain_B_4_0000100001_0000001_0
RT 0.240896 -0.969226 -0.0506967 -0.666707 -0.127294 -0.734369 0.705317 0.210707 -0.676854 -1.89952 1.90952 -2.89857   HKH_2021_1GHQ_run_1_complex.364_chain_B_4_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIHQEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_1_complex.364_chain_B_4_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_1_complex.364_chain_B_4_0000100001_0000001_0
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LkmUvCZYwSK0DfbjQkm0vCZYwSK0DfbjQkmUvCZYwUK0DfbjQ HKH_2021_1GHQ_run_1_complex.364_chain_B_4_0000100001_0000001_0
SCORE:  -1328.253  -2771.127    298.950   1856.325               -152.503                 47.216                102.419    969.133      -1059.944            -4.200                 -30.617   -902.569         -114.019       -231.852        -68.172       -104.145     -65.092       -7.051                   24.157      5.005        32.927       192.649        356.907    -95.344      86.412    -33.370       0.000         71.825        267.826   6755.000 HKH_2021_1GHQ_run_2_complex.539_chain_B_9_0000100001_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_2_complex.539_chain_B_9_0000100001_0000001_0
FOLD_TREE  EDGE 437 160 2  EDGE 160 1 -1  EDGE 160 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_2_complex.539_chain_B_9_0000100001_0000001_0
RT 0.968033 -0.160615 0.19265 -0.217813 -0.919172 0.328147 0.124373 -0.359619 -0.924773 -39.0722 30.9025 22.3941   HKH_2021_1GHQ_run_2_complex.539_chain_B_9_0000100001_0000001_0
RT -0.362661 -0.201545 -0.909866 -0.862034 -0.298406 0.409696 -0.354082 0.932917 -0.0655187 2.39558 -0.84189 3.40561   HKH_2021_1GHQ_run_2_complex.539_chain_B_9_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_2_complex.539_chain_B_9_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_2_complex.539_chain_B_9_0000100001_0000001_0
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L+TXxCZ0hPKEYjigQ+T3xCZ0hPKEYjigQ+TXxCZ0hRKEYjigQ HKH_2021_1GHQ_run_2_complex.539_chain_B_9_0000100001_0000001_0
SCORE:  -1304.070  -2745.286    296.367   1835.771               -151.489                 45.242                 98.988    965.605      -1053.566            -4.090                 -27.345   -897.210         -110.093       -232.634        -70.548       -105.229     -63.084       -6.403                   32.169      5.648        34.243       189.111        342.482    -95.170      87.634    -33.370       0.000         79.489        278.700  17702.000 HKH_2021_1GHQ_run_1_complex.170_chain_B_7_0000200002_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_1_complex.170_chain_B_7_0000200002_0000001_0
FOLD_TREE  EDGE 437 279 2  EDGE 279 1 -1  EDGE 279 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_1_complex.170_chain_B_7_0000200002_0000001_0
RT -0.872932 -0.243075 -0.422971 -0.332348 -0.338381 0.880365 -0.35712 0.909073 0.214598 18.6617 -22.8986 5.12799   HKH_2021_1GHQ_run_1_complex.170_chain_B_7_0000200002_0000001_0
RT -0.356736 -0.804005 -0.475726 -0.928632 0.249643 0.274446 -0.101894 0.53968 -0.835681 -1.22237 0.397859 0.670268   HKH_2021_1GHQ_run_1_complex.170_chain_B_7_0000200002_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKH[HIS_D]LIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDH[HIS_D]QELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_1_complex.170_chain_B_7_0000200002_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_1_complex.170_chain_B_7_0000200002_0000001_0
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LBZ8xCVHqTKU6W+jQBZcyCVHqTKU6W+jQBZ8xCVHqVKU6W+jQ HKH_2021_1GHQ_run_1_complex.170_chain_B_7_0000200002_0000001_0
SCORE:  -1306.014  -2771.611    300.500   1851.201               -151.844                 46.734                 99.190    965.497      -1058.470            -4.504                 -30.721   -889.630         -108.206       -231.671        -70.146       -101.089     -66.215       -6.645                   33.941      3.998        36.050       198.702        350.242    -95.165      83.893    -33.370       0.000         71.268        272.057   8685.000 HKH_2021_1GHQ_run_1_complex.742_chain_B_19_0000300003_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_1_complex.742_chain_B_19_0000300003_0000001_0
FOLD_TREE  EDGE 437 277 2  EDGE 277 1 -1  EDGE 277 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_1_complex.742_chain_B_19_0000300003_0000001_0
RT 0.00109154 0.582213 0.813035 0.165134 0.801769 -0.574367 -0.986271 0.134886 -0.0952678 -21.4248 -8.17405 51.5182   HKH_2021_1GHQ_run_1_complex.742_chain_B_19_0000300003_0000001_0
RT -0.423645 -0.315331 0.849171 0.178774 -0.94812 -0.262886 0.888012 0.040439 0.45804 -2.55428 -0.425245 -0.418461   HKH_2021_1GHQ_run_1_complex.742_chain_B_19_0000300003_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_1_complex.742_chain_B_19_0000300003_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_1_complex.742_chain_B_19_0000300003_0000001_0
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LM3avC5p/aKkQ8GjQM36vC5p/aKkQ8GjQM3avC5p/cKkQ8GjQ HKH_2021_1GHQ_run_1_complex.742_chain_B_19_0000300003_0000001_0
SCORE:  -1304.065  -2748.399    303.480   1835.730               -152.655                 45.997                 99.896    960.847      -1051.791            -4.202                 -27.677   -886.416         -108.661       -232.572        -70.524        -99.373     -64.514       -6.570                   26.375      2.321        33.311       193.097        345.155    -96.815      87.227    -33.370       0.000         73.213        272.822  14195.000 HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
FOLD_TREE  EDGE 437 277 2  EDGE 277 1 -1  EDGE 277 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
RT -0.905259 0.279251 0.320195 0.111847 0.883703 -0.454488 -0.409873 -0.375617 -0.831214 5.6344 -11.4086 51.747   HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
RT -0.39962 -0.106507 0.910472 0.284533 -0.958581 0.0127513 0.871404 0.264155 0.413374 -3.71506 -1.22383 -1.01637   HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
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LHJB5CF5gOKUhS2kQ2pj4CdDQMK0Hj1kQrj64C9wmJKEyL5kQXTd5ClcJJK0yfwkQ+CO4CdzJMK01YfkQPxr3CtX6JKEsmakQtbD3C5zcKKklNnkQzXi3CdA2JK0qXCkQnFS5CVG8OKkE+okQtoL4CFIhMKEnAClQNt93Ct5BOK0ildkQW2m4CZwBMKUdITkQw/33Cto+HKE2kfkQ2ur2C1r7IKkn7jkQDFK3CNkeKKUHS4kQzg32CdvWMK02IikQjHL3CFGSIKUe++jQVuV3C58vLKUAP9jQD2/3CVPbJK0mh5jQ HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
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LOWipC52KgKkWoGoQRYWpC1A2iK0PBDoQQ6spCVaLlKkxeIoQPO4pC9GAlKkH4RoQQ72pCpiGfKULBCoQVFcpCVJ6iK0lC1nQ2+zoCdwEjK0lCEoQ HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
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Lu0zoCJHFqK0EOKoQV7JoCtwwqKUYQOoQwh0nCRkIoKUZSRoQX+CoClg/lKUxFOoQ9KvnCRmMsK0PvFoQ0zmnChYYqKUDX6nQxfHoCNmluK05XBoQExzoChKtoKUvXEoQ57MoC5dAsK06XVoQEARnCJ92sKk3MJoQuASnCtXDpKkT7+nQdN0nCBBlvK0jn2nQANOoCBe+vKkn3HoQdTloC5c8tKUpp7nQ HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
LyNRnCFCQoK0IFXoQhS8mCBixlKEsZaoQepbmCdaokKkffSoQ8AHmCt/HmK0aZMoQdFnmCJpKmK0+PloQX6FnCp9AnKElfuoQlPjnCBP0kKEhkyoQ8aHoC1lTkK0qQroQZnroCxOylKk/eqoQfsxoC5r6nKkunwoQMBJpCNLFlKE7ajoQ9gFnCJxCqKk6YZoQKxUnCVMQkKEiNboQYaOmCRXsnK0ZlkoQoOXmCJQUkKkRonoQwwZnCFBqoKEasroQjxymCJGtnKUtP1oQQ7vnCV9WlK0sY6oQt+QnChA+iKk7TzoQaRFoCBqsiKUFUmoQNbboC98doK04A2oQe2MpC5CApKE12voQJbEpCxWajK0yheoQuPkpCJMKmK07nioQ HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
L9WWmCJu9hKUiXToQKQ3lCZ/YgKEkaNoQzhKlCRdVhKUrxPoQsLClCtvRiKE3nYoQ374lCFZadK0rwQoQSYemCV9tbKEUNNoQv+dmCZbGZKkkIToQ8uYmCR3EbKEihBoQZlpmCxS/gKUNkYoQu/+lC51ngKUsBFoQkx4lCBhWdKUDeZoQ7rblC9IbcKUHIOoQkZ8mCVEwcKkSsOoQyf4mCtB4XKUFdQoQeLhmChEeZKElsboQ6x/lC1gDYK0ymRoQHZymCpn0ZKE5C+nQ5q6lCRTBaKUQcAoQkUYmCRq3cKkPZ5nQ HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
LtftkC5iLhKEoBIoQcWBkCZO4hK017IoQ4QojC9p0fKk5vOoQSf1jCBvhdK03pPoQZ6yjCNjAiKEEo6nQbqOkC1TBgK0xXvnQBF5kCVqKgKEYr6nQFWtkChXFhKEjIIoQHD+jCh8wjKELKNoQuHRjCZ5dhKEc/5nQc91jCJQCkK0YR0nQ5HAkCBzCeKkjFwnQOURkCV5igKkmXenQyCHlCp0KeK0fS7nQs7MlC5SkhKkuvynQ HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
LiXDjCF6qgKkRPSoQlMiiChI5eKkyDWoQ2i8hC1CafKkMuOoQzg0hCJZthK0NqLoQcIWiCF0YfKE+3hoQs/6iCNf+eK0JcooQyBzhClMbdK0qYloQi69iCxTsiK0q9RoQ4JsiCdI0cKkwFVoQB0KiCx1bhK033ioQjmPjC9JXgKEo7moQoQrhCl9xdKEKvtoQQUWhCNssdKEqmgoQxh+hC9gYbKkgbkoQ HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
LyBnhCtaTdKkjPLoQU1BhCJUrdKEakEoQ9kagChapdK0dzLoQrUXgCZe+bKEACToQ6uAhCZigbKkId4nQIashChsmbKkCwlnQ5xuhCBvYbKUFeNoQTGEhCx9lfKUfmAoQMkChC1grZK0mSAoQh6jgCpMibK0W5vnQ HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
LIo6fCZnifKkLQKoQdDweC9LrfKk/VRoQ8fadCBF2fKEEnLoQ9CVdCJZvgKUAdCoQqh4eCx6GiK085YoQtMFgCBI2hKUCwfoQgy5eC1VskKELVSoQ+3BgCZr2gK0mDEoQSLveCR33dKEYPWoQt7BeCFCJiKkFXeoQpkHgCxsijKUBLloQo1DgCx3/fKkhXkoQSVhgCt9zhKk1maoQUQ/eCBuZmK0YrXoQ7/vfCRrpkKUs5MoQOn+dC943kKkytNoQ HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
L9+WcCBQHfKkfURoQEzAbCdPSfK0ADNoQAYkaCNzMiKETyMoQkFqZCxs7iKk21GoQBs+aChytjKEP0ToQioDaChZrdKEL/ToQhwYaChJ8aKEDCUoQhCfcCpJYeK0xxYoQuYAbChdfeKU+4EoQlAFaCN6ceK0ZIcoQCvCZC5z7dKU8+QoQhssZCZ0EaKUzGYoQ HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
Loy9uChfXcKEIEMjQoydvChfXcKEIEMjQoy9uChfXeKEIEMjQ HKH_2021_1GHQ_run_2_complex.160_chain_B_3_0000200002_0000001_0
SCORE:  -1317.057  -2712.236    288.636   1803.957               -151.199                 45.741                 97.347    952.827      -1036.280            -3.524                 -25.040   -884.774         -105.197       -232.604        -69.088        -97.379     -60.065       -6.973                   25.622      3.914        35.053       192.426        344.999    -97.862      83.543    -33.370       0.000         63.790        260.681   6249.000 HKH_2021_1GHQ_run_1_complex.1910_chain_B_21_0000100001_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_1_complex.1910_chain_B_21_0000100001_0000001_0
FOLD_TREE  EDGE 437 276 2  EDGE 276 1 -1  EDGE 276 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_1_complex.1910_chain_B_21_0000100001_0000001_0
RT -0.723882 -0.117703 -0.67981 0.689117 -0.170994 -0.704187 -0.0333581 -0.978216 0.204891 -3.48084 -15.5795 26.1998   HKH_2021_1GHQ_run_1_complex.1910_chain_B_21_0000100001_0000001_0
RT 0.24059 -0.969301 0.0507097 -0.66217 -0.202107 -0.721584 0.709681 0.140027 -0.690467 -6.25043 1.6929 -5.72411   HKH_2021_1GHQ_run_1_complex.1910_chain_B_21_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDH[HIS_D]QELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_1_complex.1910_chain_B_21_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_1_complex.1910_chain_B_21_0000100001_0000001_0
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SCORE:  -1341.826  -2768.582    294.882   1853.879               -152.512                 46.122                 98.838    973.870      -1059.011            -4.221                 -29.402   -920.883         -107.083       -232.615        -72.086       -107.485     -63.045       -6.311                   20.756      4.501        36.212       204.275        356.856    -95.066      86.197    -33.370       0.000         65.374        268.084  13840.000 HKH_2021_1GHQ_run_1_complex.544_chain_B_11_0000100001_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_1_complex.544_chain_B_11_0000100001_0000001_0
FOLD_TREE  EDGE 437 201 2  EDGE 201 1 -1  EDGE 201 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_1_complex.544_chain_B_11_0000100001_0000001_0
RT -0.850446 0.394473 0.348042 0.360001 -0.0460097 0.931817 0.38359 0.917755 -0.102882 24.4458 5.73021 12.7226   HKH_2021_1GHQ_run_1_complex.544_chain_B_11_0000100001_0000001_0
RT -0.0391544 -0.225727 -0.973403 -0.981606 0.190857 -0.00477438 0.186859 0.955312 -0.229048 0.288832 2.59395 0.86048   HKH_2021_1GHQ_run_1_complex.544_chain_B_11_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_1_complex.544_chain_B_11_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_1_complex.544_chain_B_11_0000100001_0000001_0
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SCORE:  -1360.063  -2739.926    290.876   1820.589               -153.462                 46.428                101.611    955.393      -1046.052            -4.134                 -29.241   -896.420         -114.419       -234.234        -72.319       -100.970     -67.851       -6.878                   24.347      4.761        35.092       194.592        350.154    -97.729      86.271    -33.370       0.000         66.246        260.581  14452.000 HKH_2021_1GHQ_run_2_complex.320_chain_B_9_0000200002_0000001_0
RES_NUM A:1-307 B:308-436 z:1 HKH_2021_1GHQ_run_2_complex.320_chain_B_9_0000200002_0000001_0
FOLD_TREE  EDGE 437 276 2  EDGE 276 1 -1  EDGE 276 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_2_complex.320_chain_B_9_0000200002_0000001_0
RT 0.354093 0.244425 -0.902704 0.0577375 0.957687 0.281961 0.933426 -0.15196 0.324998 -23.1391 -16.7592 -15.8929   HKH_2021_1GHQ_run_2_complex.320_chain_B_9_0000200002_0000001_0
RT 0.237577 -0.970665 -0.0369666 -0.613452 -0.120422 -0.780497 0.75315 0.208105 -0.624066 -1.80654 4.08293 -2.93391   HKH_2021_1GHQ_run_2_complex.320_chain_B_9_0000200002_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_2_complex.320_chain_B_9_0000200002_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_2_complex.320_chain_B_9_0000200002_0000001_0
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LmWWvCdJYOKUBVcjQmW2vCdJYOKUBVcjQmWWvCdJYQKUBVcjQ HKH_2021_1GHQ_run_2_complex.320_chain_B_9_0000200002_0000001_0
SCORE:  -1336.462  -2759.854    294.623   1849.477               -151.260                 44.894                 96.927    966.323      -1057.004            -4.111                 -28.344   -900.068         -100.992       -231.018        -75.859       -100.258     -63.530       -6.959                   26.557      3.364        33.944       200.253        344.678    -96.478      86.547    -33.370       0.000         65.523        259.535   1234.000 HKH_2021_1GHQ_run_2_complex.181_chain_B_4_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1GHQ_run_2_complex.181_chain_B_4_0000100001_0000001_0
RES_NUM A:1-307 B:308-437 HKH_2021_1GHQ_run_2_complex.181_chain_B_4_0000100001_0000001_0
FOLD_TREE  EDGE 437 277 2  EDGE 277 1 -1  EDGE 277 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_2_complex.181_chain_B_4_0000100001_0000001_0
RT -0.69672 0.468941 0.542841 -0.0326476 0.735225 -0.677036 -0.7166 -0.489427 -0.496936 1.40561 8.85697 63.9108   HKH_2021_1GHQ_run_2_complex.181_chain_B_4_0000100001_0000001_0
RT -0.311862 -0.234509 0.920732 0.152776 -0.968829 -0.195013 0.937764 0.0798485 0.337969 -5.36248 -2.84727 -2.97256   HKH_2021_1GHQ_run_2_complex.181_chain_B_4_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKHLIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDH[HIS_D]QELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_2_complex.181_chain_B_4_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_2_complex.181_chain_B_4_0000100001_0000001_0
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LESYkCRZSuKEJXGnQfGHkC5etrKES4/mQJfXjCtomrK0qpDnQdxHjCxK4sKU7hSnQ2HbkCh7cpKEEXNnQ3PJlCB7toKUiXJnQBgYlCdP7mKUB8anQP5LlCp6JnKkex0mQ54ukC9aTuK0y6RnQNrOkCBKerKk+GvmQ15YkCdBDqKkYEenQ76HkCNOpnKkNmLnQ+IdlCtNgqKE2vInQ0Z5lCFbYmKEhBYnQUXWlCZh+nKUrMqnQmnElCdwHlKEHjbnQHaslClIkmKEVLymQL73kCBYYlKECN2mQb9AlCxYVoKk2TnmQ HKH_2021_1GHQ_run_2_complex.181_chain_B_4_0000100001_0000001_0
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LgWKuCNAqfKU8NriQgWquCNAqfKU8NriQgWKuCNAqhKU8NriQ HKH_2021_1GHQ_run_2_complex.181_chain_B_4_0000100001_0000001_0
SCORE:  -1367.948  -2749.752    293.673   1813.928               -152.244                 45.661                 99.837    953.385      -1045.880            -4.141                 -28.599   -899.026         -108.763       -233.784        -73.758       -100.059     -73.960       -6.553                   23.311      3.371        33.896       199.498        346.732    -95.074      87.766    -33.370       0.000         71.237        264.718   7354.000 HKH_2021_1GHQ_run_1_complex.336_chain_B_6_0000100001_0000001_0
REMARK BINARY SILENTFILE HKH_2021_1GHQ_run_1_complex.336_chain_B_6_0000100001_0000001_0
RES_NUM A:1-307 B:308-437 HKH_2021_1GHQ_run_1_complex.336_chain_B_6_0000100001_0000001_0
FOLD_TREE  EDGE 437 276 2  EDGE 276 1 -1  EDGE 276 307 -1  EDGE 1 308 1  EDGE 308 436 -1  HKH_2021_1GHQ_run_1_complex.336_chain_B_6_0000100001_0000001_0
RT 0.0177648 0.664238 -0.74731 -0.289665 0.718793 0.632006 0.956963 0.205242 0.205176 -13.0507 -9.5047 -0.628506   HKH_2021_1GHQ_run_1_complex.336_chain_B_6_0000100001_0000001_0
RT 0.27121 -0.961277 -0.0488974 -0.689653 -0.158635 -0.70655 0.671434 0.225345 -0.705972 -4.3014 2.80339 -1.10364   HKH_2021_1GHQ_run_1_complex.336_chain_B_6_0000100001_0000001_0
ANNOTATED_SEQUENCE: M[MET:NtermProteinFull]LDAERLKH[HIS_D]LIVTPSGAGEQNMIGMTPTVIAVH[HIS_D]YLDETEQWEKFGLEKRQGALELIKKGYTQQLAFRQPSSAFAAFVKRAPSTWLTAYVVKVFSLAVNLIAIDSQVLC[CYS:disulfide]GAVKWLILEKQKPDGVFQEDAPVIH[HIS_D]QEMIGGLRNNNEKDMALTAFVLISLQEAKDIC[CYS:disulfide]EEQVNSLPGSITKAGDFLEANYMNLQRSYTVAIAGYALAQMGRLKGPLLNKFLTTAKDKNRWEDPGKQLYNVEATSYALLALLQLKDFDFVPPVVRWLNEQRYYGGGYGSTQATFMVFQALAQYQKDAPSDHQELNLDVSLQ[GLN:CtermProteinFull]A[ALA:NtermProteinFull]ISC[CYS:disulfide]GSPPPILNGRISYYSTPIAVGTVIRYSC[CYS:disulfide]SGTFRLIGEKSLLC[CYS:disulfide]ITKDKVDGTWDKPAPKC[CYS:disulfide]EYFNKYSSC[CYS:disulfide]PEPIVPGGYKIRGSTPYRHGDSVTFAC[CYS:disulfide]KTNFSMNGNKSVWC[CYS:disulfide]QANNMWGPTRLPTC[CYS:disulfide]VS[SER:CtermProteinFull]X HKH_2021_1GHQ_run_1_complex.336_chain_B_6_0000100001_0000001_0
NONCANONICAL_CONNECTION: 165  SG  108  SG
NONCANONICAL_CONNECTION: 353  SG  311  SG
NONCANONICAL_CONNECTION: 370  SG  339  SG
NONCANONICAL_CONNECTION: 420  SG  379  SG
NONCANONICAL_CONNECTION: 434  SG  406  SG
CHAIN_ENDINGS  307 HKH_2021_1GHQ_run_1_complex.336_chain_B_6_0000100001_0000001_0
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